Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP3A4 | P08684 | 2/20 | 0.54 |
| ▸ | CYP2B6 | P20813 | 1/20 | 0.54 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.45 |
| ▸ | LMNA | P02545 | 2/20 | 0.45 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.45 |
| ▸ | MAPK14 | Q16539 | 1/20 | 0.41 |
| ▸ | BRD4 | O60885 | 2/20 | 0.40 |
| ▸ | KAT2B | Q92831 | 1/20 | 0.40 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.40 |
| ▸ | TP53 | P04637 | 1/20 | 0.40 |
| ▸ | BRD9 | Q9H8M2 | 1/20 | 0.39 |
| ▸ | GLA | P06280 | 1/20 | 0.39 |
| ▸ | TSHR | P16473 | 1/20 | 0.39 |
| ▸ | POLB | P06746 | 1/20 | 0.38 |
| ▸ | ELANE | P08246 | 1/20 | 0.38 |
| ▸ | HTT | P42858 | 1/20 | 0.38 |
| ▸ | P2RX7 | Q99572 | 1/20 | 0.38 |
| ▸ | MEN1 | O00255 | 1/20 | 0.38 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.38 |
| ▸ | HPGD | P15428 | 1/20 | 0.37 |
Click a target to see other patent compounds predicted against it — the reverse direction, in place.
Similar compounds — the chemically nearest patent molecules
Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.
| Compound | similarity | top predicted | shared targets | |
|---|---|---|---|---|
| SCHEMBL21667279 | 0.87 | CYP3A4 (0.54) | CYP3A4CYP2B6ALDH1A1LMNAL3MBTL1 | |
| SCHEMBL21667350 | 0.86 | CYP3A4 (0.53) | CYP3A4CYP2B6ALDH1A1LMNASMN1; SMN2 | |
| SCHEMBL21667337 | 0.86 | CYP3A4 (0.53) | CYP3A4CYP2B6ALDH1A1LMNAL3MBTL1 | |
| SCHEMBL21667335 | 0.84 | CYP3A4 (0.51) | CYP3A4CYP2B6ALDH1A1L3MBTL1HTT | |
| SCHEMBL21667318 | 0.83 | CYP3A4 (0.50) | CYP3A4CYP2B6ALDH1A1LMNAL3MBTL1 | |
| SCHEMBL21667363 | 0.83 | CYP3A4 (0.50) | CYP3A4CYP2B6P2RX7 | |
| SCHEMBL20716038 | 0.83 | CYP3A4 (0.61) | CYP3A4CYP2B6ALDH1A1LMNAL3MBTL1 | |
| SCHEMBL24469599 | 0.80 | CYP3A4 (0.45) | CYP3A4CYP2B6ALDH1A1LMNAL3MBTL1 | |
| SCHEMBL21667347 | 0.79 | CYP3A4 (0.50) | CYP3A4CYP2B6ALDH1A1LMNAL3MBTL1 | |
| SCHEMBL21667339 | 0.78 | CYP3A4 (0.46) | CYP3A4CYP2B6ALDH1A1LMNAL3MBTL1 |
Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.
Patent provenance — the patents this molecule appears in, and who filed them
Claimed or disclosed in 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-3702352-A1 | PYRIMIDINEDIONE COMPOUND AGAINST CARDIAC CONDITIONS | Myokardia, Inc. (US) | 2020-09-02 | — | — | EP | disclosed |
| EP-3010910-B1 | PYRIMIDINEDIONE COMPOUNDS AGAINST CARDIAC CONDITIONS | MYOKARDIA INC (US) | 2020-02-05 | — | — | EP | disclosed |